5YSP
Pyrophosphate-dependent kinase in the ribokinase family complexed with a pyrophosphate analog and myo-inositol
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL41XU |
Synchrotron site | SPring-8 |
Beamline | BL41XU |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2016-10-08 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 1.000 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 46.673, 63.009, 89.884 |
Unit cell angles | 90.00, 105.05, 90.00 |
Refinement procedure
Resolution | 50.000 - 1.700 |
R-factor | 0.19713 |
Rwork | 0.196 |
R-free | 0.21042 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1vk4 |
RMSD bond length | 0.010 |
RMSD bond angle | 1.382 |
Data scaling software | HKL-2000 (715) |
Phasing software | MOLREP (11.2.08) |
Refinement software | REFMAC (5.8.0103) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.730 |
High resolution limit [Å] | 1.700 | 1.700 |
Number of reflections | 54308 | |
<I/σ(I)> | 24.8 | |
Completeness [%] | 98.1 | |
Redundancy | 3.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 4.6 | 293 | PEG 4000, ammonium sulfate, sodium acetate |